SCHEMBL23117635

SCHEMBL23117635

CC(=O)c1ccc(CN(C)C(=O)C2CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PYCR1 P32322 1/20 0.54
POLB P06746 2/20 0.50
KMT2A Q03164 4/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
MEN1 O00255 1/20 0.44
PKM P14618 1/20 0.43
HTT P42858 1/20 0.43
LMNA P02545 1/20 0.42
HRH3 Q9Y5N1 1/20 0.40
LPAR1 Q92633 1/20 0.40
LPAR5 Q9H1C0 1/20 0.40
TSHR P16473 1/20 0.40
RIPK1 Q13546 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5790489 0.81 POLB (0.69) POLBKMT2ASMN1; SMN2MEN1PKM
SCHEMBL20680717 0.81 POLB (0.45) POLBKMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL31725230 0.79 PYCR1 (0.59) PYCR1POLBKMT2ASMN1; SMN2ALDH1A1
SCHEMBL2238302 0.79 ALDH1A1 (0.69) PYCR1POLBKMT2ASMN1; SMN2ALDH1A1
SCHEMBL23117637 0.78 PLOD2 (0.49) POLBKMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL13450089 0.76 POLB (0.63) POLBKMT2ASMN1; SMN2ALDH1A1MEN1
SCHEMBL3154235 0.76 POLB (0.63) POLBKMT2ASMN1; SMN2MEN1PKM
SCHEMBL26522756 0.76 POLB (0.49) PYCR1POLBKMT2ASMN1; SMN2ALDH1A1
SCHEMBL24636855 0.75 POLB (0.66) POLBKMT2ASMN1; SMN2ALDH1A1MEN1
SCHEMBL26522945 0.75 KMT2A (0.50) POLBKMT2ASMN1; SMN2ALDH1A1MEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3619207-B1 SUBSTITUTED 5-(HALOALKYL)-5-HYDROXY-ISOXAZOLINES FOR COMBATING PHYTOPATHOGENIC FUNGI BASF SE (DE) 2021-06-23 EP disclosed
US-20210084900-A1 Substituted 5-(haloalkyl)-5-hydroxy-isoxazoles for Combating Phytopathogenic Fungi BASF SE (DE) 2021-03-25 US disclosed
CN-110621669-A Substituted 5-haloalkyl-5-hydroxyisoxazoles for controlling phytopathogenic fungi 巴斯夫欧洲公司 2019-12-27 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210084900-A1 Substituted 5-(haloalkyl)-5-hydroxy-isoxazoles for Combating Phytopathogenic Fungi HAX1, HAO1, HAO2 PYCR1 2014/4885POLB 3943/4885KMT2A 3360/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.